Glycoside
...
GD007277

Name:
None

Formula:
C22H31O15N10P3S3

Smiles:
Nc1ncnc2c1ncn2[C@H]1O[C@@H](COP(O)(=S)OC(COP(O)(=S)OC[C@H]2O[C@@H](n3cnc4c(N)ncnc43)[C@H](O)[C@H]2O)OP(O)(O)=S)[C@H](O)[C@H]1O

Aglycone:
COP(O)(=S)OCC(OP(O)(O)=S)OP(O)(=S)OC.Nc1ncnc2c1N=C[N]2.Nc1ncnc2c1N=C[N]2

Sugarmoiety:
OC1OC(O)C(O)C1O.OC1OC(O)C(O)C1O

Other Identifiers

Properties
HBA: 25 RingCount: 6
HBD: 12 FractionCSP3: 0.55
AlogP: -2.88 Num_rotatable_bonds: 15
MolWt: 864.67 Num_heavy_atoms: 53
TPSA: 365.69 NumAromaticRings: 4

Unique Aglycone
AD00058
Formula: C5H4N5

Smiles:
Nc1ncnc2c1N=C[N]2
HBA: 5 RingCount: 2
HBD: 2 FractionCSP3: 0.0
AlogP: -0.03 Num_rotatable_bonds: 0
MolWt: 134.12 Num_heavy_atoms: 10
TPSA: 78.26 NumAromaticRings: 1
AD05935
Formula: C4H13O9P3S3

Smiles:
COP(O)(=S)OCC(OP(O)(O)=S)OP(O)(=S)OC
HBA: 9 RingCount: 0
HBD: 4 FractionCSP3: 1.0
AlogP: 0.3 Num_rotatable_bonds: 9
MolWt: 394.26 Num_heavy_atoms: 19
TPSA: 127.07 NumAromaticRings: 0

Sugarmoiety
SD00025

OC1OC(O)C(O)C1O.OC1OC(O)C(O)C1O